[4-(4-cyanophenyl)phenyl] benzoate; 3-methanidylperoxy-2-methyl-prop-1-ene; osmium(2+)

Systemtic Name: [4-(4-cyanophenyl)phenyl] benzoate; 3-methanidylperoxy-2-methyl-prop-1-ene; osmium(2+) Openeye Name: [4-(4-cyanophenyl)phenyl] benzoate; 3-methanidylperoxy-2-methyl-prop-1-ene; osmium(2+) CAS Name: benzoic acid [4-(4-cyanophenyl)phenyl] ester; 3-methanidyldioxy-2-methyl-1-propene; osmium(2+) IUPAC Name: [4-(4-cyanophenyl)phenyl] benzoate; 3-methanidylperoxy-2-methylprop-1-ene; osmium(2+) Traditional Name: benzoic acid [4-(4-cyanophenyl)phenyl] ester; 3-methanidylperoxy-2-methyl-prop-1-ene; osmium(2+) Formula: C25H21NO4Os MolecularWeight: 589.66854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COO[CH2-].C1=CC(=CC=[C-]1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N.[Os+2]

Isomeric SMILES

CC(=C)COO[CH2-].C1=CC(=CC=[C-]1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N.[Os+2]

InChI

InChI=1S/C20H12NO2.C5H9O2.Os/c21-14-15-6-8-16(9-7-15)17-10-12-19(13-11-17)23-20(22)18-4-2-1-3-5-18;1-5(2)4-7-6-3;/h2-13H;1,3-4H2,2H3;/q2*-1;+2